SCHEMBL29801653

SCHEMBL29801653

O=C1N=C(Nc2ccccc2C(F)(F)F)S/C1=C\c1c[nH]c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
MYC P01106 1/20 0.38
MAX P61244 1/20 0.38
KDM4E B2RXH2 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP2A6 P11509 1/20 0.36
IMPDH2 P12268 1/20 0.36
NTRK1 P04629 2/20 0.36
RET P07949 2/20 0.36
DAPK3 O43293 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
ABL1 P00519 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19859142 1.00 MAPT (0.40) MAPTMYCMAXKDM4EKMT2A
SCHEMBL21074348 0.84 PRKCB (0.44) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL21074335 0.84 MAPT (0.45) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL19859238 0.84 ALDH1A1 (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL29801609 0.84 ALDH1A1 (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL29801729 0.84 PRKCB (0.44) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL23361928 0.81 MEN1 (0.39) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL21048269 0.81 MEN1 (0.39) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL19859148 0.81 PTGS1 (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL29801554 0.81 MEN1 (0.39) MAPTKDM4EKMT2AALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4066832-A1 PHARMACEUTICAL COMPOSITION FOR TREATING MULTIPLE SCLEROSIS ON BASIS OF AMPK INHIBITORY FUNCTION AND ZINC HOMEOSTASIS CONTROL FUNCTION Zincure Corp. (KR) 2022-10-05 EP claimed
CN-114929217-A Pharmaceutical composition for treating multiple sclerosis based on AMPK inhibitory function and zinc homeostasis control function 锌医疗公司 2022-08-19 CN claimed
US-12343335-B2 Pharmaceutical composition for treating multiple sclerosis on basis of AMPK inhibitory function and zinc homeostasis control function ZINCURE CORP. (KR) 2025-07-01 US disclosed
US-20230000839-A1 PHARMACEUTICAL COMPOSITION FOR TREATING MULTIPLE SCLEROSIS ON BASIS OF AMPK INHIBITORY FUNCTION AND ZINC HOMEOSTASIS CONTROL FUNCTION ZINCURE CORP. (KR) 2023-01-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230000839-A1 PHARMACEUTICAL COMPOSITION FOR TREATING MULTIPLE SCLEROSIS ON BASIS OF AMPK INHIBITORY FUNCTION AND ZINC HOMEOSTASIS CONTROL FUNCTION PRKAB1, PRKAB2, PRKAG1 MAPT 517/4885MYC 4007/4885MAX 2655/4885
US-12343335-B2 Pharmaceutical composition for treating multiple sclerosis on basis of AMPK inhibitory function and zinc homeostasis control function PRKAB1, PRKAB2, PRKAG1 MAPT 517/4885MYC 4007/4885MAX 2655/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.